COC(=O)c1cccc(C=CC2CC(NC(=O)OC(C)(C)C)CCC2NC(=O)OCc2ccccc2)c1
SMILES: COC(=O)c1cccc(C=CC2CC(NC(=O)OC(C)(C)C)CCC2NC(=O)OCc2ccccc2)c1

Molecular Processing

Molecular formula
C29H36N2O6
Molecular weight
508.62
Exact mass
508.2573
XLogP
5.47
TPSA
102.96
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
37
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.414
Molar refractivity
140.86

Supplementary Information

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